7-[2-(6-azanylhexylamino)-5-methyl-imidazo[1,5-b]pyridazin-7-yl]-1-phenyl-heptan-1-one

Systemtic Name: 7-[2-(6-azanylhexylamino)-5-methyl-imidazo[1,5-b]pyridazin-7-yl]-1-phenyl-heptan-1-one Openeye Name: 7-[2-(6-aminohexylamino)-5-methyl-imidazo[1,5-b]pyridazin-7-yl]-1-phenyl-heptan-1-one CAS Name: 7-[2-(6-aminohexylamino)-5-methyl-7-imidazo[1,5-b]pyridazinyl]-1-phenyl-1-heptanone IUPAC Name: 7-[2-(6-aminohexylamino)-5-methylimidazo[1,5-b]pyridazin-7-yl]-1-phenylheptan-1-one Traditional Name: 7-[2-(6-aminohexylamino)-5-methyl-imidazo[1,5-b]pyridazin-7-yl]-1-phenyl-heptan-1-one Formula: C26H37N5O MolecularWeight: 435.60488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=CC(=NN2C(=N1)CCCCCCC(=O)C3=CC=CC=C3)NCCCCCCN

Isomeric SMILES

CC1=C2C=CC(=NN2C(=N1)CCCCCCC(=O)C3=CC=CC=C3)NCCCCCCN

InChI

InChI=1S/C26H37N5O/c1-21-23-17-18-25(28-20-12-5-4-11-19-27)30-31(23)26(29-21)16-10-3-2-9-15-24(32)22-13-7-6-8-14-22/h6-8,13-14,17-18H,2-5,9-12,15-16,19-20,27H2,1H3,(H,28,30)